0 B8R1.8 C1=CSC(=C1)CC=O LN01815545 [1,0,0,0,0,0|0,1,0]=2 1 B8R1.8 N#CCC1=CC=CS1 AC510689 [1,0,0,0,0,0|1,1,1]=4 2 B8R1.8 NCCC1=CC=CO1 AC030027 [1,0,0,0,0,0|1,0,1]=3 3 B10R1.66 OC(=O)CCC1=NC=CS1 AC181494 [0,1,0,0,0,0|2,1,0]=4 4 B10R1.66 OC(=O)CCN1C=CC=N1 AC190113 [0,1,0,0,0,0|3,0,0]=4 5 B10R2.32 O=C1CCC2=C1SC=C2 AC181664 [0,0,0,1,0,0|3,0,0]=4 6 B10R1.17 O=CC#CC1=CC=CC=C1 AC500018 [0,0,0,0,0,1|2,0,1]=4 7 B7R1.1 BrCC1=CC=NO1 AC050627 [2,0,0,0,0,0|2,0,0]=4 8 B7R1.1 C1=CC=C([CH-]1)CO LN02135120 [2,0,0,0,0,0|1,0,1]=4 9 B7R1.1 C1=CNC(=C1)C=O LN00008368 [2,0,0,0,0,0|1,0,0]=3 10 B7R1.1 ClCC1=NC=CO1 AC050434 [2,0,0,0,0,0|2,0,0]=4 11 B7R1.1 NCC1=CC=CN1 AC182788 [2,0,0,0,0,0|2,0,0]=4 12 B7R1.1 NCC1=CC=CS1 AC510712 [2,0,0,0,0,0|1,1,0]=4 13 B7R1.1 O=CC1=CC=CN1 AC180090 [2,0,0,0,0,0|1,0,0]=3 14 B7R1.1 O=CC1=CC=CS1 AC511013 [2,0,0,0,0,0|0,1,0]=3 15 B7R1.1 O=CC1=CN=CO1 AC051098 [2,0,0,0,0,0|1,0,0]=3 16 B7R1.1 O=CC1=CN=CS1 AC181432 [2,0,0,0,0,0|1,1,0]=4 17 B7R1.1 O=CC1=CNC=C1 AC280042 [2,0,0,0,0,0|2,0,0]=4 18 B7R1.1 O=CC1=CNC=N1 AC180818 [2,0,0,0,0,0|2,0,0]=4 19 B7R1.1 O=CC1=CSC=C1 AC180098 [2,0,0,0,0,0|2,0,0]=4 20 B7R1.1 O=CC1=CSC=N1 AC511667 [2,0,0,0,0,0|2,0,0]=4 21 B7R1.1 O=CC1=NC=CS1 AC180755 [2,0,0,0,0,0|1,1,0]=4 22 B7R1.1 O=CC1=NNC=C1 AC200098 [2,0,0,0,0,0|2,0,0]=4 23 B7R1.1 OCC1=CC=NO1 AC050733 [2,0,0,0,0,0|1,0,1]=4 24 B7R1.1 OCC1=CN=CO1 AC182363 [2,0,0,0,0,0|1,0,1]=4 25 B9R1.13 CC(=O)CC1=CC=CS1 LN00166067 [1,1,0,0,0,0|0,1,0]=3 26 B9R1.13 OC(=O)CC1=CC=CS1 AC130136 [1,1,0,0,0,0|0,1,0]=3 27 B9R1.13 OC(=O)CC1=CSC=C1 AC130133 [1,1,0,0,0,0|2,0,0]=4 28 B9R1.13 OC(=O)CC1=NC=CS1 AC181403 [1,1,0,0,0,0|1,1,0]=4 29 B9R1.13 OC(=O)CC1=NNC=C1 AC050212 [1,1,0,0,0,0|2,0,0]=4 30 B9R1.13 OC(=O)CC1=NNC=C1 AC050253 [1,1,0,0,0,0|2,0,0]=4 31 B9R1.13 OC(=O)CN1C=CC=N1 AC180911 [1,1,0,0,0,0|2,0,0]=4 32 B11R1.24 BrC1=CC=CC(CCC=O)=C1 AC020270 [0,1,0,0,0,1|2,0,0]=4 33 B11R1.91 NC(=O)OCC1=CC=CC=C1 AC511867 [0,1,0,0,0,1|1,1,0]=4 34 B11R1.35 N[C@H](CC1=CC=CS1)C(O)=O AC021680 [0,2,0,0,0,0|1,1,0]=4 35 B9R1.2 OC1=CC=CC(C=O)=C1 AC130074 [0,0,1,1,0,0|1,0,1]=4 36 B11R2.1 O=C1CCC2=C1C=CC=C2 AC220153 [0,0,0,1,0,1|2,0,0]=4 37 B11R2.1 O=C1CCC2=CC=CN=C12 AC182161 [0,0,0,1,0,1|2,0,0]=4 38 B11R2.1 O=C1CCC2=NC=CC=C12 AC511871 [0,0,0,1,0,1|2,0,0]=4 39 B11R2.1 O=C1NCC2=CC=CC=C12 AC511115 [0,0,0,1,0,1|2,0,0]=4 40 B11R2.106 O=C1CCCC2=C1C=CS2 AC020430 [0,1,0,1,0,0|1,1,0]=4 41 B11R2.106 O=C1NC=CC2=C1C=CO2 AC180843 [0,1,0,1,0,0|1,0,1]=4